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	hartrees
Energy at 0K	-54.065152
Energy at 298.15K
HF Energy	-53.441998
Nuclear repulsion energy	75.899330

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A	3777	3599	34.31	50.25	0.24	0.39
2	A	3192	3041	35.63	47.31	0.73	0.85
3	A	3162	3013	28.77	74.73	0.49	0.66
4	A	3107	2961	31.39	123.75	0.11	0.19
5	A	3071	2926	43.52	112.10	0.14	0.24
6	A	1539	1467	2.86	3.33	0.73	0.85
7	A	1531	1459	3.85	10.32	0.75	0.86
8	A	1461	1392	35.71	4.15	0.44	0.61
9	A	1426	1359	26.81	3.12	0.74	0.85
10	A	1397	1331	3.43	8.66	0.74	0.85
11	A	1275	1214	8.03	9.79	0.70	0.82
12	A	1232	1174	15.80	5.43	0.74	0.85
13	A	1141	1088	0.95	2.69	0.29	0.45
14	A	1115	1063	91.62	5.26	0.68	0.81
15	A	1058	1008	66.91	3.00	0.68	0.81
16	A	903	861	15.80	6.44	0.31	0.47
17	A	871	830	42.02	5.22	0.33	0.50
18	A	516	492	14.82	0.92	0.74	0.85
19	A	423	403	139.35	2.01	0.72	0.84
20	A	322	307	19.65	0.34	0.50	0.66
21	A	158	151	12.16	0.04	0.45	0.62

Atom	x (Å)	y (Å)	z (Å)
C1	0.685	0.584	0.293
C2	-0.719	0.570	-0.291
O3	1.466	-0.517	-0.192
F4	-1.369	-0.608	0.160
H5	1.204	1.493	-0.025
H6	0.623	0.573	1.391
H7	-1.314	1.424	0.050
H8	-0.691	0.522	-1.383
H9	0.974	-1.323	0.049

	C1	C2	O3	F4	H5	H6	H7	H8	H9
C1		1.5201	1.4352	2.3782	1.0945	1.0991	2.1812	2.1692	1.9444
C2	1.5201		2.4423	1.4189	2.1496	2.1510	1.0952	1.0935	2.5620
O3	1.4352	2.4423		2.8582	2.0348	2.0992	3.3991	2.6738	0.9741
F4	2.3782	1.4189	2.8582		3.3272	2.6225	2.0356	2.0290	2.4524
H5	1.0945	2.1496	2.0348	3.3272		1.7854	2.5197	2.5256	2.8268
H6	1.0991	2.1510	2.0992	2.6225	1.7854		2.5041	3.0693	2.3497
H7	2.1812	1.0952	3.3991	2.0356	2.5197	2.5041		1.8041	3.5749
H8	2.1692	1.0935	2.6738	2.0290	2.5256	3.0693	1.8041		2.8679
H9	1.9444	2.5620	0.9741	2.4524	2.8268	2.3497	3.5749	2.8679

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	F4	107.985	C1	C2	H7	112.002
C1	C2	H8	111.138	C1	O3	H9	106.031
C2	C1	O3	111.434	C2	C1	H5	109.522
C2	C1	H6	109.368	O3	C1	H5	106.320
O3	C1	H6	111.163

All results from a given calculation for CH₂FCH₂OH (2-fluoroethanol)

using model chemistry: MP2/CEP-121G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH2FCH2OH (2-fluoroethanol)

using model chemistry: MP2/CEP-121G*

States and conformations

All results from a given calculation for CH₂FCH₂OH (2-fluoroethanol)